N-propan-2-yl-4,5-dihydro-1H-imidazol-2-amine

C6H13N3 — CID 11715178

IUPACN-propan-2-yl-4,5-dihydro-1H-imidazol-2-amine
SMILESCC(C)NC1=NCCN1
InChIInChI=1S/C6H13N3/c1-5(2)9-6-7-3-4-8-6/h5H,3-4H2,1-2H3,(H2,7,8,9)
InChIKeyMEWFQWCZHSJROJ-UHFFFAOYSA-N
MW127.19 g/mol
LogP-0.06
Rot. Bonds1

About N-propan-2-yl-4,5-dihydro-1H-imidazol-2-amine

N-propan-2-yl-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 11715178) has the molecular formula C6H13N3 and a molecular weight of 127.19 g/mol. Its IUPAC name is N-propan-2-yl-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-propan-2-yl-4,5-dihydro-1H-imidazol-2-amine
PubChem CID11715178
Molecular FormulaC6H13N3
Molecular Weight127.19 g/mol
Exact Mass127.11
IUPAC NameN-propan-2-yl-4,5-dihydro-1H-imidazol-2-amine
SMILESCC(C)NC1=NCCN1
InChIInChI=1S/C6H13N3/c1-5(2)9-6-7-3-4-8-6/h5H,3-4H2,1-2H3,(H2,7,8,9)
InChIKeyMEWFQWCZHSJROJ-UHFFFAOYSA-N
XLogP-0.06
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-propan-2-yl-4,5-dihydro-1H-imidazol-2-amine (CID 11715178) is N-propan-2-yl-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-propan-2-yl-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-propan-2-yl-4,5-dihydro-1H-imidazol-2-amine is CC(C)NC1=NCCN1.
What is the InChIKey of N-propan-2-yl-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is MEWFQWCZHSJROJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3/c1-5(2)9-6-7-3-4-8-6/h5H,3-4H2,1-2H3,(H2,7,8,9).
What are the key properties of N-propan-2-yl-4,5-dihydro-1H-imidazol-2-amine?
N-propan-2-yl-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 127.19 g/mol, XLogP of -0.06, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 11715178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).